CID 58847

Malononitrile, (n,n-diisopropylaminomethylene)-

Structural Information

Molecular Formula
C10H15N3
SMILES
CC(C)N(C=C(C#N)C#N)C(C)C
InChI
InChI=1S/C10H15N3/c1-8(2)13(9(3)4)7-10(5-11)6-12/h7-9H,1-4H3
InChIKey
GZNBLQWWPVVOGL-UHFFFAOYSA-N
Compound name
2-[[di(propan-2-yl)amino]methylidene]propanedinitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.1266 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.13388 154.7
[M+Na]+ 200.11582 161.7
[M-H]- 176.11932 157.4
[M+NH4]+ 195.16042 168.0
[M+K]+ 216.08976 161.5
[M+H-H2O]+ 160.12386 139.7
[M+HCOO]- 222.12480 166.0
[M+CH3COO]- 236.14045 220.5
[M+Na-2H]- 198.10127 154.0
[M]+ 177.12605 146.9
[M]- 177.12715 146.9
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.