CID 3047647

63867-76-5

Structural Information

Molecular Formula
C9H17N
SMILES
CC1=CCCC(N1C)(C)C
InChI
InChI=1S/C9H17N/c1-8-6-5-7-9(2,3)10(8)4/h6H,5,7H2,1-4H3
InChIKey
JNOZNCBBHYHMBY-UHFFFAOYSA-N
Compound name
1,2,2,6-tetramethyl-3,4-dihydropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.1361 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.143376 129.3
[M+Na]+ 162.125318 137.5
[M-H]- 138.128824 131.9
[M+NH4]+ 157.169923 152.3
[M+K]+ 178.099258 136.5
[M+H-H2O]+ 122.133360 124.3
[M+HCOO]- 184.134301 149.8
[M+CH3COO]- 198.149951 176.6
[M+Na-2H]- 160.110766 135.5
[M]+ 139.13555142 127.9
[M]- 139.13664858 127.9
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

No patent data available for this compound.