CID 88611

20602-77-1

Structural Information

Molecular Formula
C9H17NO2
SMILES
CC(=C)C(=O)OCCCN(C)C
InChI
InChI=1S/C9H17NO2/c1-8(2)9(11)12-7-5-6-10(3)4/h1,5-7H2,2-4H3
InChIKey
WWJCRUKUIQRCGP-UHFFFAOYSA-N
Compound name
3-(dimethylamino)propyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

10128
Patents

171.12593 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.13321 140.4
[M+Na]+ 194.11515 146.0
[M-H]- 170.11865 141.9
[M+NH4]+ 189.15975 161.2
[M+K]+ 210.08909 147.0
[M+H-H2O]+ 154.12319 135.0
[M+HCOO]- 216.12413 163.7
[M+CH3COO]- 230.13978 187.8
[M+Na-2H]- 192.10060 142.9
[M]+ 171.12538 143.5
[M]- 171.12648 143.5
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