CID 39457

46499-86-9

Structural Information

Molecular Formula
C13H20N2O
SMILES
CCOC(C1=CC=CC=C1)C(=NC(C)C)N
InChI
InChI=1S/C13H20N2O/c1-4-16-12(13(14)15-10(2)3)11-8-6-5-7-9-11/h5-10,12H,4H2,1-3H3,(H2,14,15)
InChIKey
OESWXOBSRAZJQR-UHFFFAOYSA-N
Compound name
2-ethoxy-2-phenyl-N'-propan-2-ylethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

220.15756 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.164836 154.5
[M+Na]+ 243.146778 158.4
[M-H]- 219.150284 158.3
[M+NH4]+ 238.191383 172.4
[M+K]+ 259.120718 157.4
[M+H-H2O]+ 203.154820 147.1
[M+HCOO]- 265.155761 178.0
[M+CH3COO]- 279.171411 198.2
[M+Na-2H]- 241.132226 156.7
[M]+ 220.15701142 153.9
[M]- 220.15810858 153.9
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

patents stripe