CID 3065365

Succinamide, n-(5-isopropyl-1,3,4-thiadiazol-2-yl)-n'-propyl-

Structural Information

Molecular Formula
C12H20N4O2S
SMILES
CCCNC(=O)CCC(=O)NC1=NN=C(S1)C(C)C
InChI
InChI=1S/C12H20N4O2S/c1-4-7-13-9(17)5-6-10(18)14-12-16-15-11(19-12)8(2)3/h8H,4-7H2,1-3H3,(H,13,17)(H,14,16,18)
InChIKey
JVXYTWMYJYBVTL-UHFFFAOYSA-N
Compound name
N'-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-N-propylbutanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.1307 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.13798 167.6
[M+Na]+ 307.11992 172.7
[M-H]- 283.12342 168.5
[M+NH4]+ 302.16452 182.4
[M+K]+ 323.09386 170.3
[M+H-H2O]+ 267.12796 159.4
[M+HCOO]- 329.12890 183.8
[M+CH3COO]- 343.14455 204.0
[M+Na-2H]- 305.10537 165.8
[M]+ 284.13015 170.8
[M]- 284.13125 170.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.