CID 45714

63957-05-1

Structural Information

Molecular Formula
C6H13NO
SMILES
CC(C)(C)N(C)C=O
InChI
InChI=1S/C6H13NO/c1-6(2,3)7(4)5-8/h5H,1-4H3
InChIKey
GZKMWSAXNHPVJH-UHFFFAOYSA-N
Compound name
N-tert-butyl-N-methylformamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1219
Patents

115.09972 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 123.6
[M+Na]+ 138.08894 131.0
[M-H]- 114.09244 125.8
[M+NH4]+ 133.13354 147.1
[M+K]+ 154.06288 132.5
[M+H-H2O]+ 98.096980 119.5
[M+HCOO]- 160.09792 147.9
[M+CH3COO]- 174.11357 176.2
[M+Na-2H]- 136.07439 130.9
[M]+ 115.09917 125.6
[M]- 115.10027 125.6
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

patents stripe