CID 81043

6554-73-0

Structural Information

Molecular Formula
C8H15NO
SMILES
CC(=C)C(=O)NC(C)(C)C
InChI
InChI=1S/C8H15NO/c1-6(2)7(10)9-8(3,4)5/h1H2,2-5H3,(H,9,10)
InChIKey
QQZXAODFGRZKJT-UHFFFAOYSA-N
Compound name
N-tert-butyl-2-methylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

7107
Patents

141.11537 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.122646 132.3
[M+Na]+ 164.104588 138.6
[M-H]- 140.108094 132.8
[M+NH4]+ 159.149193 153.9
[M+K]+ 180.078528 138.4
[M+H-H2O]+ 124.112630 128.2
[M+HCOO]- 186.113571 153.6
[M+CH3COO]- 200.129221 178.7
[M+Na-2H]- 162.090036 136.8
[M]+ 141.11482142 131.6
[M]- 141.11591858 131.6
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