CID 528619

15924-91-1

Structural Information

Molecular Formula
C8H15NO
SMILES
CC(C)(C)NC(=O)C1CC1
InChI
InChI=1S/C8H15NO/c1-8(2,3)9-7(10)6-4-5-6/h6H,4-5H2,1-3H3,(H,9,10)
InChIKey
IGGMKEYOISAENY-UHFFFAOYSA-N
Compound name
N-tert-butylcyclopropanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

233
Patents

141.11537 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 130.7
[M+Na]+ 164.104588 138.9
[M-H]- 140.108094 135.6
[M+NH4]+ 159.149193 147.6
[M+K]+ 180.078528 137.4
[M+H-H2O]+ 124.112630 125.5
[M+HCOO]- 186.113571 153.3
[M+CH3COO]- 200.129221 180.7
[M+Na-2H]- 162.090036 137.1
[M]+ 141.11482142 132.7
[M]- 141.11591858 132.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe