CID 10197657

(s)-2,2-dimethylcyclopropanecarboxamide

Structural Information

Molecular Formula
C6H11NO
SMILES
CC1(C[C@@H]1C(=O)N)C
InChI
InChI=1S/C6H11NO/c1-6(2)3-4(6)5(7)8/h4H,3H2,1-2H3,(H2,7,8)/t4-/m1/s1
InChIKey
YBZQRYWKYBZZNT-SCSAIBSYSA-N
Compound name
(1S)-2,2-dimethylcyclopropane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

193
Patents

113.08406 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.091336 121.7
[M+Na]+ 136.073278 131.7
[M-H]- 112.076784 126.8
[M+NH4]+ 131.117883 141.3
[M+K]+ 152.047218 130.7
[M+H-H2O]+ 96.081320 117.8
[M+HCOO]- 158.082261 145.3
[M+CH3COO]- 172.097911 175.9
[M+Na-2H]- 134.058726 128.0
[M]+ 113.08351142 123.4
[M]- 113.08460858 123.4
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