CID 3033597

73816-39-4

Structural Information

Molecular Formula
C10H18N6S2
SMILES
CC1(C(=NNC(=S)N)C(C1=NNC(=S)N)(C)C)C
InChI
InChI=1S/C10H18N6S2/c1-9(2)5(13-15-7(11)17)10(3,4)6(9)14-16-8(12)18/h1-4H3,(H3,11,15,17)(H3,12,16,18)
InChIKey
KSUFJHSFYCATLI-UHFFFAOYSA-N
Compound name
[[3-(carbamothioylhydrazinylidene)-2,2,4,4-tetramethylcyclobutylidene]amino]thiourea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

286.10342 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.11070 170.8
[M+Na]+ 309.09264 168.9
[M+NH4]+ 304.13724 174.8
[M+K]+ 325.06658 161.1
[M-H]- 285.09614 170.1
[M+Na-2H]- 307.07809 172.3
[M]+ 286.10287 169.6
[M]- 286.10397 169.6
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.