CID 3024831

N-(1,2,2-trimethylpropyl)formamide

Structural Information

Molecular Formula
C7H15NO
SMILES
CC(C(C)(C)C)NC=O
InChI
InChI=1S/C7H15NO/c1-6(8-5-9)7(2,3)4/h5-6H,1-4H3,(H,8,9)
InChIKey
NFBFERYHCPXWCC-UHFFFAOYSA-N
Compound name
N-(3,3-dimethylbutan-2-yl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

226
Patents

129.11537 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 129.3
[M+Na]+ 152.104588 135.9
[M-H]- 128.108094 129.8
[M+NH4]+ 147.149193 151.4
[M+K]+ 168.078528 136.1
[M+H-H2O]+ 112.112630 125.1
[M+HCOO]- 174.113571 151.7
[M+CH3COO]- 188.129221 176.5
[M+Na-2H]- 150.090036 135.5
[M]+ 129.11482142 129.7
[M]- 129.11591858 129.7
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

patents stripe